(2S)-N-[4-(aminomethyl)phenyl]-2-(azepan-1-yl)propanamide

Systemtic Name: (2S)-N-[4-(aminomethyl)phenyl]-2-(azepan-1-yl)propanamide Openeye Name: (2S)-N-[4-(aminomethyl)phenyl]-2-(azepan-1-yl)propanamide CAS Name: (2S)-N-[4-(aminomethyl)phenyl]-2-(1-azepanyl)propanamide IUPAC Name: (2S)-N-[4-(aminomethyl)phenyl]-2-(azepan-1-yl)propanamide Traditional Name: (2S)-N-[4-(aminomethyl)phenyl]-2-(azepan-1-yl)propionamide Formula: C16H25N3O MolecularWeight: 275.3892

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)CN)N2CCCCCC2

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=C(C=C1)CN)N2CCCCCC2

InChI

InChI=1S/C16H25N3O/c1-13(19-10-4-2-3-5-11-19)16(20)18-15-8-6-14(12-17)7-9-15/h6-9,13H,2-5,10-12,17H2,1H3,(H,18,20)/t13-/m0/s1